⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL38692 | 1.00 | — | — | |
| SCHEMBL11869556 | 0.79 | — | — | |
| SCHEMBL1618844 | 0.77 | GABRP (0.41) | — | |
| SCHEMBL4606844 | 0.77 | GABRP (0.41) | — | |
| SCHEMBL11662399 | 0.77 | — | — | |
| SCHEMBL3980505 | 0.77 | — | — | |
| SCHEMBL23275485 | 0.74 | — | — | |
| SCHEMBL3987485 | 0.74 | — | — | |
| SCHEMBL170621 | 0.72 | — | — | |
| SCHEMBL4711266 | 0.72 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5039437-A | — | — | None | — | — | JP | disclosed |
| JP-H0539437-A | TWO-STAGE CURING COATING COMPOUND COMPOSITION | NIPPON YUPIKA KK | 1993-02-19 | — | — | JP | disclosed |
| US-4379862-A | Process for the preparation of polyurethane resins using low molecular weight polyhydroxyl compounds prepared by the condensation of formaldehyde | BAYER AKTIENGESELLSCHAFT (DE) | 1983-04-12 | — | — | US | disclosed |
| US-4301310-A | USING SYNTHESIS GAS DIRECTLY AS THE SOURCE OF FORMALDEHYDE | BAYER AKTIENGESELLSCHAFT (DE) | 1981-11-17 | — | — | US | disclosed |
| US-4219508-A | FROM CONDENSATION OF UNPURIFIED FORMALDEHYDE | BAYER AKTIENGESELLSCHAFT (DE) | 1980-08-26 | — | — | US | disclosed |
| US-4144208-A | ACRYLATE COPOLYMER, ACETOACETIC ACID ESTER CROSSLINKING AGENT | DEUTSCHE TEXACO AKTIENGESELLSCHAFT (DE) | 1979-03-13 | — | — | US | disclosed |